methane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine

C38H65N11OS — CID 157371957

IUPACmethane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine
SMILESC.C.CC(C)c1ccnc(N)c1.CC(C)c1cnc(N)nc1.CC(C)c1cnc(N)o1.CC(C)c1cnc(N)s1.Cc1cc(C(C)C)cc(N)n1
InChIInChI=1S/C9H14N2.C8H12N2.C7H11N3.C6H10N2O.C6H10N2S.2CH4/c1-6(2)8-4-7(3)11-9(10)5-8;1-6(2)7-3-4-10-8(9)5-7;1-5(2)6-3-9-7(8)10-4-6;2*1-4(2)5-3-8-6(7)9-5;;/h4-6H,1-3H3,(H2,10,11);3-6H,1-2H3,(H2,9,10);3-5H,1-2H3,(H2,8,9,10);2*3-4H,1-2H3,(H2,7,8);2*1H4
InChIKeyBJWHZOBKTBSMGC-UHFFFAOYSA-N
MW724.08 g/mol
LogP9.57
Rot. Bonds5

About methane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine

methane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine (PubChem CID 157371957) has the molecular formula C38H65N11OS and a molecular weight of 724.08 g/mol. Its IUPAC name is methane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Namemethane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine
PubChem CID157371957
Molecular FormulaC38H65N11OS
Molecular Weight724.08 g/mol
Exact Mass723.51
IUPAC Namemethane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine
SMILESC.C.CC(C)c1ccnc(N)c1.CC(C)c1cnc(N)nc1.CC(C)c1cnc(N)o1.CC(C)c1cnc(N)s1.Cc1cc(C(C)C)cc(N)n1
InChIInChI=1S/C9H14N2.C8H12N2.C7H11N3.C6H10N2O.C6H10N2S.2CH4/c1-6(2)8-4-7(3)11-9(10)5-8;1-6(2)7-3-4-10-8(9)5-7;1-5(2)6-3-9-7(8)10-4-6;2*1-4(2)5-3-8-6(7)9-5;;/h4-6H,1-3H3,(H2,10,11);3-6H,1-2H3,(H2,9,10);3-5H,1-2H3,(H2,8,9,10);2*3-4H,1-2H3,(H2,7,8);2*1H4
InChIKeyBJWHZOBKTBSMGC-UHFFFAOYSA-N
XLogP9.57
TPSA220.58 Ų
H-Bond Donors5
H-Bond Acceptors13
Rotatable Bonds5
Heavy Atoms51
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500724.08
LogP ≤ 59.57
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1013

Analyze methane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine with MolForge

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Launch Full Analysis

Related Compounds

2-(1,3-Oxazol-5-yl)-6-(1-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine
CID 45274622
2-(1,3-Oxazol-5-yl)-6-(1-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine;hydrochloride
CID 68587257
2-(1,3-Oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine;hydrochloride
CID 68605447
Ethane;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole
CID 158753127
Ethane;5-methyl-1,3-oxazole;3-methylpyridine;5-methylpyrimidine;5-methyl-1,3-thiazole
CID 159018347
2-Methyl-5-propan-2-yl-1,3-oxazole;6-methyl-4-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-yl-1,3-thiazole;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine
CID 160685224
Methane;6-methyl-4-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1,3-oxazol-2-amine;5-propan-2-yl-1,3-thiazol-2-amine
CID 161688553
2-Methyl-5-propan-2-yl-1,3-oxazole;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine
CID 161977021
4-Tert-butylpyridazine;4-tert-butylpyridine;4-tert-butylpyrimidine;2,4-dideuterio-5-(2,2-dimethylpropyl)-1,3-oxazole;2,4-dideuterio-5-(2,2-dimethylpropyl)-1,3-thiazole;ethane
CID 161977624
1,8-Naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole
CID 174511237
2-(1,3-Oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine
CID 68605448

Frequently Asked Questions

What is the IUPAC name of methane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine?
The IUPAC name of methane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine (CID 157371957) is methane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for methane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for methane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine is C.C.CC(C)c1ccnc(N)c1.CC(C)c1cnc(N)nc1.CC(C)c1cnc(N)o1.CC(C)c1cnc(N)s1.Cc1cc(C(C)C)cc(N)n1.
What is the InChIKey of methane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine?
The InChIKey is BJWHZOBKTBSMGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2.C8H12N2.C7H11N3.C6H10N2O.C6H10N2S.2CH4/c1-6(2)8-4-7(3)11-9(10)5-8;1-6(2)7-3-4-10-8(9)5-7;1-5(2)6-3-9-7(8)10-4-6;2*1-4(2)5-3-8-6(7)9-5;;/h4-6H,1-3H3,(H2,10,11);3-6H,1-2H3,(H2,9,10);3-5H,1-2H3,(H2,8,9,10);2*3-4H,1-2H3,(H2,7,8);2*1H4.
What are the key properties of methane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine?
methane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine has a molecular weight of 724.08 g/mol, XLogP of 9.57, 5 rotatable bonds, 5 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for methane;6-methyl-4-propan-2-ylpyridin-2-amine;5-propan-2-yl-1,3-oxazol-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyrimidin-2-amine;5-propan-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 157371957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).